L4AI9H -OEChem-05022323122D 44 47 0 1 0 0 0 0 0999 V2000 11.1107 1.4682 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.2938 0.6934 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.5190 -0.4896 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.3979 -2.5644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7527 -2.0228 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 2.5333 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3991 -0.3273 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7328 0.4185 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7123 0.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0547 1.4091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 0.9945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3518 2.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3364 1.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 0.9945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7183 1.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3780 -0.1231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3424 0.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 2.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 0.4185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0443 -0.8688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6907 0.8267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0232 -0.6647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6697 1.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3359 0.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7316 -1.8187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3149 0.4893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5378 -0.1701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1824 -0.1120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9387 -0.3675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6029 1.1194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4339 1.8996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8742 2.5117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1122 2.7496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 3.1533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2052 -0.9162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5408 -0.3776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5182 2.7696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 -0.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 1.5404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2776 1.2891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4363 -1.1271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8635 1.6198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2040 -3.1533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 27 1 0 0 0 0 3 27 1 0 0 0 0 4 26 1 0 0 0 0 4 44 1 0 0 0 0 5 26 2 0 0 0 0 6 13 1 0 0 0 0 6 15 1 0 0 0 0 6 35 1 0 0 0 0 8 7 1 1 0 0 0 7 16 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 14 15 1 0 0 0 0 14 17 2 0 0 0 0 15 18 2 0 0 0 0 16 20 2 0 0 0 0 16 22 1 0 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 18 21 1 0 0 0 0 18 38 1 0 0 0 0 19 21 2 0 0 0 0 19 39 1 0 0 0 0 20 23 1 0 0 0 0 20 26 1 0 0 0 0 21 40 1 0 0 0 0 22 24 2 0 0 0 0 22 41 1 0 0 0 0 23 25 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 27 1 0 0 0 0 M END $$$$